8-methyl-2-[[(5-methylthiophen-2-yl)methyl-phenethyl-amino]methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 8-methyl-2-[[(5-methylthiophen-2-yl)methyl-phenethyl-amino]methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 8-methyl-2-[[(5-methyl-2-thienyl)methyl-phenethyl-amino]methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 8-methyl-2-[[(5-methyl-2-thiophenyl)methyl-phenethylamino]methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 8-methyl-2-[[(5-methylthiophen-2-yl)methyl-phenethylamino]methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 8-methyl-2-[[(5-methyl-2-thienyl)methyl-phenethyl-amino]methyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C23H31N4O2S+ MolecularWeight: 427.58284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)CN3C(=O)C4(CC[NH+](CC4)C)NC3=O

Isomeric SMILES

CC1=CC=C(S1)CN(CCC2=CC=CC=C2)CN3C(=O)C4(CC[NH+](CC4)C)NC3=O

InChI

InChI=1S/C23H30N4O2S/c1-18-8-9-20(30-18)16-26(13-10-19-6-4-3-5-7-19)17-27-21(28)23(24-22(27)29)11-14-25(2)15-12-23/h3-9H,10-17H2,1-2H3,(H,24,29)/p+1